Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

XDV

Summary
Name:2-[2-(2-aminoethoxy)ethoxy]acetamide
Formula:C6 H14 N2 O3
Formal charge:0
Formula weight:162.187 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-[2-(2-aminoethoxy)ethoxy]acetamide
OpenEye OEToolkits2.0.72-[2-(2-azanylethoxy)ethoxy]ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01NC(COCCOCCN)=O
InChIInChI1.03InChI=1S/C6H14N2O3/c7-1-2-10-3-4-11-5-6(8)9/h1-5,7H2,(H2,8,9)
InChIKeyInChI1.03CDFONQZJZPNQML-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCCOCCOCC(N)=O
SMILESCACTVS3.385NCCOCCOCC(N)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C(COCCOCC(=O)N)N
SMILESOpenEye OEToolkits2.0.7C(COCCOCC(=O)N)N

227344

PDB entries from 2024-11-13

PDB statisticsPDBj update infoContact PDBjnumon